General Information of the Compound
| Compound ID |
CP0382181
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| Compound Name |
2-[3-(1-benzyl-6-oxopyridin-3-yl)-2-methylindol-1-yl]acetic acid
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| Structure |
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| Formula |
C23H20N2O3
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| Molecular Weight |
372.424
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| Canonical SMILES |
Cc1c(-c2ccc(=O)n(Cc3ccccc3)c2)c2ccccc2n1CC(O)=O
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| InChI |
InChI=1S/C23H20N2O3/c1-16-23(19-9-5-6-10-20(19)25(16)15-22(27)28)18-11-12-21(26)24(14-18)13-17-7-3-2-4-8-17/h2-12,14H,13,15H2,1H3,(H,27,28)
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| InChIKey |
DHXXOIFBEVMKQX-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound